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CHEBI:23057 - cathasterone

ChEBI IDCHEBI:23057
ChEBI Namecathasterone
Stars
Last Modified17 December 2021
DownloadsMolfile
FormulaC28H48O3
Net Charge0
Average Mass432.689
Monoisotopic Mass432.36035
SMILES[H][C@@]12CC(=O)[C@@]3([H])C[C@@H](O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1([H])[C@H](C)[C@@H](O)C[C@@H](C)C(C)C
InChIInChI=1S/C28H48O3/c1-16(2)17(3)13-25(30)18(4)21-7-8-22-20-15-26(31)24-14-19(29)9-11-28(24,6)23(20)10-12-27(21,22)5/h16-25,29-30H,7-15H2,1-6H3/t17-,18+,19+,20+,21-,22+,23+,24-,25+,27-,28-/m1/s1
InChIKeyJSVPGVHCEQDJCZ-VGEHDTSWSA-N
ChEBI Ontology
Outgoing Relation(s)
cathasterone (CHEBI:23057) is a (22S)-22-hydroxy C28-steroid (CHEBI:188922)
cathasterone (CHEBI:23057) is a 22-hydroxy steroid (CHEBI:36863)
cathasterone (CHEBI:23057) is a 3β-hydroxy steroid (CHEBI:36836)
cathasterone (CHEBI:23057) is a 6-oxo steroid (CHEBI:36883)
cathasterone (CHEBI:23057) is a C28-steroid (CHEBI:188921)
cathasterone (CHEBI:23057) is a phytosteroid (CHEBI:26124)
Incoming Relation(s)
6-deoxycathasterone (CHEBI:20714) has functional parent cathasterone (CHEBI:23057)
IUPAC Name 
(22S)-3β,22-dihydroxy-5α-campestan-6-one
Synonym  Source
6-oxo-campestan-3β,22R-diolLIPID MAPS
UniProt Name  Source
cathasteroneUniProt
Manual XrefsDatabases
LMST01030132LIPID MAPS
C15790KEGG COMPOUND
C00007275KNApSAcK
Registry NumbersSources
Beilstein:7416517Beilstein